[(1S,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 3,4-bis(oxidanyl)benzoate

Systemtic Name: [(1S,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 3,4-bis(oxidanyl)benzoate Openeye Name: [(1S,4S)-1,7,7-trimethylnorbornan-2-yl] 3,4-dihydroxybenzoate CAS Name: 3,4-dihydroxybenzoic acid [(1S,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] ester IUPAC Name: [(1S,4S)-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl] 3,4-dihydroxybenzoate Traditional Name: 3,4-dihydroxybenzoic acid [(1S,4S)-1,7,7-trimethylnorbornan-2-yl] ester Formula: C17H22O4 MolecularWeight: 290.35418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(C2)OC(=O)C3=CC(=C(C=C3)O)O)C)C

Isomeric SMILES

C[C@]12CC[C@H](C1(C)C)CC2OC(=O)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C17H22O4/c1-16(2)11-6-7-17(16,3)14(9-11)21-15(20)10-4-5-12(18)13(19)8-10/h4-5,8,11,14,18-19H,6-7,9H2,1-3H3/t11-,14?,17+/m0/s1